1-[1-(2,3-dimethylphenyl)-3,4-dihydro-2H-pyrrol-1-ium-5-yl]-3-(4-methoxyphenyl)thiourea

Systemtic Name: 1-[1-(2,3-dimethylphenyl)-3,4-dihydro-2H-pyrrol-1-ium-5-yl]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-[1-(2,3-dimethylphenyl)-3,4-dihydro-2H-pyrrol-1-ium-5-yl]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[1-(2,3-dimethylphenyl)-3,4-dihydro-2H-pyrrol-1-ium-5-yl]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[1-(2,3-dimethylphenyl)-3,4-dihydro-2H-pyrrol-1-ium-5-yl]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-[1-(2,3-dimethylphenyl)-1-pyrrolin-1-ium-2-yl]-3-(4-methoxyphenyl)thiourea Formula: C20H24N3OS+ MolecularWeight: 354.48906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+]2=C(CCC2)NC(=S)NC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)[N+]2=C(CCC2)NC(=S)NC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C20H23N3OS/c1-14-6-4-7-18(15(14)2)23-13-5-8-19(23)22-20(25)21-16-9-11-17(24-3)12-10-16/h4,6-7,9-12H,5,8,13H2,1-3H3,(H,21,25)/p+1